3-chloranyl-6-methoxy-N-[(4-phenoxyphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methoxy-N-[(4-phenoxyphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-methoxy-N-[(4-phenoxyphenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methoxy-N-[(4-phenoxyanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methoxy-N-[(4-phenoxyphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-methoxy-N-[(4-phenoxyphenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C23H17ClN2O3S2 MolecularWeight: 468.97568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H17ClN2O3S2/c1-28-17-11-12-18-19(13-17)31-21(20(18)24)22(27)26-23(30)25-14-7-9-16(10-8-14)29-15-5-3-2-4-6-15/h2-13H,1H3,(H2,25,26,27,30)